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EVODEX.1-P5651

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[C:1]([C:2]([C:3]([C:4]([C:5]([C:6](=[O:7])[N:8]([C:9]1:[C:10]([H:16]):[C:11]([H:17]):[C:12]([H:18]):[C:13]([H:19]):[C:14]:1[H:20])[H:21])([H:22])[H:23])([H:24])[H:25])([H:26])[H:27])([H:28])[H:29])([H:30])([H:31])[H:32].[H][O:15][H:33]>>[C:1]([C:2]([C:3]([C:4]([C:5]([C:6](=[O:7])[O:15][H:33])([H:22])[H:23])([H:24])[H:25])([H:26])[H:27])([H:28])[H:29])([H:30])([H:31])[H:32].[H][N:8]([C:9]1:[C:10]([H:16]):[C:11]([H:17]):[C:12]([H:18]):[C:13]([H:19]):[C:14]:1[H:20])[H:21]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E134 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:15]-[#6:16](=[#8:17])-[#7:18](-[#6:19])-[H:33].[#8:28](-[H:65])-[H]>>[#6:15]-[#6:16](=[#8:17])-[#8:28]-[H:65].[#7:18](-[#6:19])(-[H:33])-[H]

EVODEX.1-C12 - Reaction Operator C

Reaction Operator C SMIRKS

[#7:23]-[#6:24].[H]-[#8:1]>>[H]-[#7:23].[#8:1]-[#6:24]

EVODEX.1-N93 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:7]-[#6:8](=[#8:9])-[#7:10](-[#6:11])-[H:30].[H]-[#8:23]-[H:39]>>[#6:7]-[#6:8](=[#8:9])-[#8:23]-[H:39].[H]-[#7:10](-[#6:11])-[H:30]

EVODEX.1-Em51 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:5]-[#6:6](=[#8:7])-[#7:8]-[#6:9].[H]-[#8:15]>>[#6:5]-[#6:6](=[#8:7])-[#8:15].[H]-[#7:8]-[#6:9]

EVODEX.1-Cm24 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#7:23]-[#6:24].[H]-[#8:1]>>[H]-[#7:23].[#8:1]-[#6:24]

EVODEX.1-Nm49 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:7]-[#6:8](=[#8:9])-[#7:10]-[#6:11].[H]-[#8:23]>>[#6:7]-[#6:8](=[#8:9])-[#8:23].[H]-[#7:10]-[#6:11]

Source Full Reactions

EVODEX.1-R6373

Full Reaction Rendering

[C:1]([C:2]([C:3]([C:4]([C:5]([C:6](=[O:7])[N:8]([C:9]1:[C:10]([H:16]):[C:11]([H:17]):[C:12]([H:18]):[C:13]([H:19]):[C:14]:1[H:20])[H:21])([H:22])[H:23])([H:24])[H:25])([H:26])[H:27])([H:28])[H:29])([H:30])([H:31])[H:32].[H][O:15][H:33]>>[C:1]([C:2]([C:3]([C:4]([C:5]([C:6](=[O:7])[O:15][H:33])([H:22])[H:23])([H:24])[H:25])([H:26])[H:27])([H:28])[H:29])([H:30])([H:31])[H:32].[H][N:8]([C:9]1:[C:10]([H:16]):[C:11]([H:17]):[C:12]([H:18]):[C:13]([H:19]):[C:14]:1[H:20])[H:21]